N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide

C19H18FN3O2 — CID 154686347

IUPACN-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
SMILESCc1cc(F)c(-c2ccc3nc(NC(=O)C4CC4)cn3c2)c(CO)c1
InChIInChI=1S/C19H18FN3O2/c1-11-6-14(10-24)18(15(20)7-11)13-4-5-17-21-16(9-23(17)8-13)22-19(25)12-2-3-12/h4-9,12,24H,2-3,10H2,1H3,(H,22,25)
InChIKeyGIESHSNMLHTHNA-UHFFFAOYSA-N
MW339.37 g/mol
LogP3.29
Rot. Bonds4

About N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide

N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide (PubChem CID 154686347) has the molecular formula C19H18FN3O2 and a molecular weight of 339.37 g/mol. Its IUPAC name is N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
PubChem CID154686347
Molecular FormulaC19H18FN3O2
Molecular Weight339.37 g/mol
Exact Mass339.14
IUPAC NameN-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
SMILESCc1cc(F)c(-c2ccc3nc(NC(=O)C4CC4)cn3c2)c(CO)c1
InChIInChI=1S/C19H18FN3O2/c1-11-6-14(10-24)18(15(20)7-11)13-4-5-17-21-16(9-23(17)8-13)22-19(25)12-2-3-12/h4-9,12,24H,2-3,10H2,1H3,(H,22,25)
InChIKeyGIESHSNMLHTHNA-UHFFFAOYSA-N
XLogP3.29
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-[3-chloro-6-fluoro-2-(hydroxymethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
CID 154686220
N-[6-[3-fluoro-2-(hydroxymethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
CID 154686210
N-[6-(3,4-difluoro-2-methylphenyl)imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
CID 155081984
N-[6-(3-fluoro-2-methylphenyl)imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
CID 154686082
N-[6-[3-chloro-2-fluoro-6-(hydroxymethyl)phenyl]imidazo[1,2-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
CID 155069416
cis-(1S,2S)-2-fluoro-N-[6-(2-fluoro-6-methylphenyl)imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide
CID 155069451
N-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)cyclopropanecarboxamide
CID 58158532
N-[6-(5-ethenyl-6-fluoro-1H-indazol-4-yl)imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
CID 164718371
N-[6-(6-amino-3-pyridinyl)imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
CID 155082189
N-[6-[5-[hydroxy(methoxy)methyl]-2-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
CID 154686025
N-[6-[5-(methylamino)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide
CID 164718424
2-fluoro-N-[6-[5-(hydroxymethyl)-1H-indol-4-yl]imidazo[1,2-a]pyridin-2-yl]cyclopropane-1-carboxamide
CID 154686179

Frequently Asked Questions

What is the IUPAC name of N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide?
The IUPAC name of N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide (CID 154686347) is N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide is Cc1cc(F)c(-c2ccc3nc(NC(=O)C4CC4)cn3c2)c(CO)c1.
What is the InChIKey of N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide?
The InChIKey is GIESHSNMLHTHNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O2/c1-11-6-14(10-24)18(15(20)7-11)13-4-5-17-21-16(9-23(17)8-13)22-19(25)12-2-3-12/h4-9,12,24H,2-3,10H2,1H3,(H,22,25).
What are the key properties of N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide?
N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide has a molecular weight of 339.37 g/mol, XLogP of 3.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[2-fluoro-6-(hydroxymethyl)-4-methylphenyl]imidazo[1,2-a]pyridin-2-yl]cyclopropanecarboxamide is sourced from PubChem (CID 154686347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).